source: src/UIElements/Qt4/QtMainWindow.cpp@ 98dbee

Action_Thermostats Add_AtomRandomPerturbation Add_FitFragmentPartialChargesAction Add_RotateAroundBondAction Add_SelectAtomByNameAction Added_ParseSaveFragmentResults AddingActions_SaveParseParticleParameters Adding_Graph_to_ChangeBondActions Adding_MD_integration_tests Adding_ParticleName_to_Atom Adding_StructOpt_integration_tests AtomFragments Automaking_mpqc_open AutomationFragmentation_failures Candidate_v1.5.4 Candidate_v1.6.0 Candidate_v1.6.1 ChangeBugEmailaddress ChangingTestPorts ChemicalSpaceEvaluator CombiningParticlePotentialParsing Combining_Subpackages Debian_Package_split Debian_package_split_molecuildergui_only Disabling_MemDebug Docu_Python_wait EmpiricalPotential_contain_HomologyGraph EmpiricalPotential_contain_HomologyGraph_documentation Enable_parallel_make_install Enhance_userguide Enhanced_StructuralOptimization Enhanced_StructuralOptimization_continued Example_ManyWaysToTranslateAtom Exclude_Hydrogens_annealWithBondGraph FitPartialCharges_GlobalError Fix_BoundInBox_CenterInBox_MoleculeActions Fix_ChargeSampling_PBC Fix_ChronosMutex Fix_FitPartialCharges Fix_FitPotential_needs_atomicnumbers Fix_ForceAnnealing Fix_IndependentFragmentGrids Fix_ParseParticles Fix_ParseParticles_split_forward_backward_Actions Fix_PopActions Fix_QtFragmentList_sorted_selection Fix_Restrictedkeyset_FragmentMolecule Fix_StatusMsg Fix_StepWorldTime_single_argument Fix_Verbose_Codepatterns Fix_fitting_potentials Fixes ForceAnnealing_goodresults ForceAnnealing_oldresults ForceAnnealing_tocheck ForceAnnealing_with_BondGraph ForceAnnealing_with_BondGraph_continued ForceAnnealing_with_BondGraph_continued_betteresults ForceAnnealing_with_BondGraph_contraction-expansion FragmentAction_writes_AtomFragments FragmentMolecule_checks_bonddegrees GeometryObjects Gui_Fixes Gui_displays_atomic_force_velocity ImplicitCharges IndependentFragmentGrids IndependentFragmentGrids_IndividualZeroInstances IndependentFragmentGrids_IntegrationTest IndependentFragmentGrids_Sole_NN_Calculation JobMarket_RobustOnKillsSegFaults JobMarket_StableWorkerPool JobMarket_unresolvable_hostname_fix MoreRobust_FragmentAutomation ODR_violation_mpqc_open PartialCharges_OrthogonalSummation PdbParser_setsAtomName PythonUI_with_named_parameters QtGui_reactivate_TimeChanged_changes Recreated_GuiChecks Rewrite_FitPartialCharges RotateToPrincipalAxisSystem_UndoRedo SaturateAtoms_findBestMatching SaturateAtoms_singleDegree StoppableMakroAction Subpackage_CodePatterns Subpackage_JobMarket Subpackage_LinearAlgebra Subpackage_levmar Subpackage_mpqc_open Subpackage_vmg Switchable_LogView ThirdParty_MPQC_rebuilt_buildsystem TrajectoryDependenant_MaxOrder TremoloParser_IncreasedPrecision TremoloParser_MultipleTimesteps TremoloParser_setsAtomName Ubuntu_1604_changes stable
Last change on this file since 98dbee was 5aaa43, checked in by Frederik Heber <heber@…>, 12 years ago

FIX: Fixed new copyright line since start of 2013 in CodeChecks test.

  • we must look for either Uni Bonn or myself.
  • added second copyright line since from 1st of Jan 2013 I am not employed by University of Bonn anymore, hence changes to the code are my own copyright.
  • Property mode set to 100644
File size: 5.3 KB
RevLine 
[bcf653]1/*
2 * Project: MoleCuilder
3 * Description: creates and alters molecular systems
[0aa122]4 * Copyright (C) 2010-2012 University of Bonn. All rights reserved.
[5aaa43]5 * Copyright (C) 2013 Frederik Heber. All rights reserved.
[94d5ac6]6 *
7 *
8 * This file is part of MoleCuilder.
9 *
10 * MoleCuilder is free software: you can redistribute it and/or modify
11 * it under the terms of the GNU General Public License as published by
12 * the Free Software Foundation, either version 2 of the License, or
13 * (at your option) any later version.
14 *
15 * MoleCuilder is distributed in the hope that it will be useful,
16 * but WITHOUT ANY WARRANTY; without even the implied warranty of
17 * MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the
18 * GNU General Public License for more details.
19 *
20 * You should have received a copy of the GNU General Public License
21 * along with MoleCuilder. If not, see <http://www.gnu.org/licenses/>.
[bcf653]22 */
23
[3027f8]24/*
[4cf323d]25 * QtMainWindow.cpp
[3027f8]26 *
27 * Created on: Jan 14, 2010
28 * Author: crueger
29 */
30
[bf3817]31// include config.h
32#ifdef HAVE_CONFIG_H
33#include <config.h>
34#endif
[bbbad5]35
[4cf323d]36#include "QtMainWindow.hpp"
[3027f8]37
[8f67e2]38#include<Qt/qapplication.h>
[fa27ed]39#include<Qt/qlabel.h>
40#include<Qt/qstring.h>
41#include<Qt/qmenubar.h>
[cef1d7]42#include<Qt/qsplitter.h>
[7641d4]43#include<Qt/qtoolbar.h>
[b82101]44#include<Qt/qsettings.h>
[22d01e]45#include<Qt/qmessagebox.h>
46#include<Qt/qevent.h>
[8f67e2]47
[3027f8]48#include<iostream>
[b2531f]49#include<map>
50
[fa27ed]51#include<boost/bind.hpp>
52
[a08d3c0]53#include "Menu/Qt4/QtMenu.hpp"
[0eb7bf3]54#include "Views/Qt4/QtMoleculeList.hpp"
[0e6156]55#include "Views/Qt4/QtElementList.hpp"
[301bc2]56#include "Views/Qt4/QtShapeController.hpp"
[3c53fa]57#include "Views/Qt4/QtInfoBox.hpp"
[a08d3c0]58#include "Views/Qt4/QtStatusBar.hpp"
[7641d4]59#include "Views/Qt4/QtToolBar.hpp"
[04f017]60#include "Views/Qt4/Qt3D/GLWorldView.hpp"
[a08d3c0]61
[ad011c]62#include "CodePatterns/MemDebug.hpp"
[bbbad5]63
[6f0841]64#include "Atom/atom.hpp"
[fa27ed]65#include "molecule.hpp"
[ad011c]66#include "CodePatterns/Verbose.hpp"
[b2531f]67#include "Actions/Action.hpp"
68#include "Actions/ActionRegistry.hpp"
[22d01e]69#include "Parser/ChangeTracker.hpp"
70#include "Parser/FormatParserStorage.hpp"
71#include "Actions/WorldAction/OutputAction.hpp"
72#include "Actions/WorldAction/OutputAsAction.hpp"
73
[5b991a]74
[22d01e]75using namespace MoleCuilder;
[3027f8]76
[4cf323d]77QtMainWindow::QtMainWindow(QApplication *_theApp) :
[8f67e2]78 theApp(_theApp)
[fa27ed]79{
[d5307b]80 Q_INIT_RESOURCE(icons);
[b82101]81 QCoreApplication::setOrganizationName("ins");
82 QCoreApplication::setOrganizationDomain("ins.uni-bonn.de");
83 QCoreApplication::setApplicationName("MoleCuilder");
[cef1d7]84 QSplitter *splitter1 = new QSplitter (Qt::Horizontal, this );
85 QSplitter *splitter2 = new QSplitter (Qt::Vertical, splitter1 );
[4458b0]86 QSplitter *splitter3 = new QSplitter (Qt::Vertical, splitter1 );
[244f81]87 QTabWidget *worldTab = new QTabWidget(splitter2);
[cef1d7]88
[0eb7bf3]89 moleculeList = new QtMoleculeList(worldTab);
[0e6156]90 elementList = new QtElementList(worldTab);
[301bc2]91 shapeController = new QtShapeController(worldTab);
[cef1d7]92
[3c53fa]93 infoBox = new QtInfoBox();
[0eb7bf3]94 glWorldView = new GLWorldView(this);
95// glWorldView->setSizePolicy( QSizePolicy::Minimum,QSizePolicy::Minimum);
96 glWorldView->setMinimumSize( QSize(640,480) );
97// glWorldView->setFocus();
98 glWorldView->camera()->setEye( QVector3D(0,3,10));
[cef1d7]99
[b59da6]100 MainMenu = new QtMenu<QMenuBar>(menuBar(), "");
101 MainMenu->init();
[b80021]102
[7641d4]103 toolbar = new QtToolBar(this);
[0eb7bf3]104 glWorldView->addToolBarActions(toolbar);
[7641d4]105 addToolBar(toolbar);
106
[cef1d7]107 setCentralWidget(splitter1);
108 splitter1->addWidget(splitter2);
[4458b0]109 splitter1->addWidget(splitter3);
110 splitter1->setStretchFactor(0, 10);
111 splitter3->addWidget(infoBox);
[301bc2]112 splitter3->addWidget(shapeController);
[0eb7bf3]113 splitter2->addWidget(glWorldView);
[244f81]114 splitter2->addWidget(worldTab);
[0eb7bf3]115 worldTab->addTab(moleculeList, "Molecules");
[0e6156]116 worldTab->addTab(elementList, "All Elements");
[cef1d7]117
[4cf323d]118 statusBar = new QtStatusBar(this);
[326a43b]119 setStatusBar(statusBar);
[fa27ed]120
[b82101]121 QSettings settings;
122 settings.beginGroup("MainWindow");
123 resize(settings.value("size", QSize(400, 400)).toSize());
124 move(settings.value("position", QPoint(200, 200)).toPoint());
125 if (settings.value("maximized", false).toBool())
126 showMaximized();
127 settings.endGroup();
128
[3c53fa]129 connect(glWorldView,SIGNAL(hoverChanged(const atom*)), infoBox,SLOT(atomHover(const atom*)));
[fa27ed]130}
[3027f8]131
[4cf323d]132QtMainWindow::~QtMainWindow()
[992fd7]133{
[b82101]134 QSettings settings;
135 settings.beginGroup("MainWindow");
136 settings.setValue("size", size());
137 settings.setValue("position", pos());
138 settings.setValue("maximized", isMaximized());
139 settings.endGroup();
140
[992fd7]141 menuBar()->clear();
[da8f97]142 delete MainMenu;
[992fd7]143}
[3027f8]144
[4cf323d]145void QtMainWindow::display() {
[8f67e2]146 this->show();
[c8bbf2]147 this->update();
[8f67e2]148 theApp->exec();
[3027f8]149}
[b2531f]150
[5125f6]151void QtMainWindow::closeEvent(QCloseEvent *event)
152{
[22d01e]153 if (ChangeTracker::getInstance().hasChanged()){
154 int ret = QMessageBox::question(this, tr("MoleCuilder"),
155 tr("The world has been modified.\n"
156 "Do you want to save your changes?"),
157 QMessageBox::Save | QMessageBox::Discard | QMessageBox::Cancel,
158 QMessageBox::Save);
159 switch(ret){
160 case QMessageBox::Cancel:
161 event->ignore();
162 return;
163 case QMessageBox::Save:
164 if (FormatParserStorage::getInstance().isAbleToSave())
165 MoleCuilder::WorldOutput();
166 else{
167 Action* action = ActionRegistry::getInstance().getActionByName("output-as");
168 try{
169 action->call();
170 }catch(...){
171 ELOG(1, "Action failed or cancelled");
172 }
173 }
174 break;
175 }
176 }
[5125f6]177 QMainWindow::closeEvent(event);
178}
179
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